2-[2-[(1R)-1-azaniumyl-2-phenyl-ethyl]benzimidazol-1-yl]ethanoate

Systemtic Name: 2-[2-[(1R)-1-azaniumyl-2-phenyl-ethyl]benzimidazol-1-yl]ethanoate Openeye Name: 2-[2-[(1R)-1-azaniumyl-2-phenyl-ethyl]benzimidazol-1-yl]acetate CAS Name: 2-[2-[(1R)-1-ammonio-2-phenylethyl]-1-benzimidazolyl]acetate IUPAC Name: 2-[2-[(1R)-1-azaniumyl-2-phenylethyl]benzimidazol-1-yl]acetate Traditional Name: 2-[2-[(1R)-1-ammonio-2-phenyl-ethyl]benzimidazol-1-yl]acetate Formula: C17H17N3O2 MolecularWeight: 295.33578

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C2=NC3=CC=CC=C3N2CC(=O)[O-])[NH3+]

Isomeric SMILES

C1=CC=C(C=C1)C[C@H](C2=NC3=CC=CC=C3N2CC(=O)[O-])[NH3+]

InChI

InChI=1S/C17H17N3O2/c18-13(10-12-6-2-1-3-7-12)17-19-14-8-4-5-9-15(14)20(17)11-16(21)22/h1-9,13H,10-11,18H2,(H,21,22)/t13-/m1/s1